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Dotarizine

pharmaceutical raw materials
Dotarizine structure

Dotarizine 

structure
  • CAS No:

    84625-59-2

  • Formula:

    C29H34N2O2

  • Chemical Name:

    Dotarizine

  • Synonyms:

    Piperazine,1-(diphenylmethyl)-4-[3-(2-phenyl-1,3-dioxolan-2-yl)propyl]-;1-(Diphenylmethyl)-4-[3-(2-phenyl-1,3-dioxolan-2-yl)propyl]piperazine;Dotarizine;1-Benzhydryl-4-(3-(2-phenyl-1,3-dioxolan-2-yl)propyl)piperazine

Description

Dotarizine is an N-alkylpiperazine in which the two amino hydrogens of piperazine have been replaced by diphenylmethyl and 3-(2-phenyl-1,3-dioxolan-2-yl)propyl groups. A calcium channel blocker and serotonin (5-HT2) receptor antagonist used in the treatment of migraine. It has a role as a calcium channel blocker, a serotonergic antagonist and a vasodilator agent. It is a N-alkylpiperazine, a dioxolane and a cyclic ketal.

Dotarizine Basic Attributes

442.59200

442.59

IO7663S6D3

DTXSID60233630

2933599090

Characteristics

24.94000

4.94940

1.122 g/cm3

100-101ºC

557.4ºC at 760 mmHg

147.9ºC

1.587

Drug Information

Investigated for use/treatment in migraine and cluster headaches.

A class of drugs that act by selective inhibition of calcium influx through cellular membranes. (See all compounds classified as Calcium Channel Blockers.)|Drugs that bind to but do not activate serotonin receptors, thereby blocking the actions of serotonin or SEROTONIN RECEPTOR AGONISTS. (See all compounds classified as Serotonin Antagonists.)|Drugs used to cause dilation of the blood vessels. (See all compounds classified as Vasodilator Agents.)

1-(diphenylmethyl)-4-(3-(2-phenyl-1,3-dioxalen-2-yl)propyl)piperazine

Computed Properties

Molecular Weight:442.6
XLogP3:4.9
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:8
Exact Mass:442.262028332
Monoisotopic Mass:442.262028332
Topological Polar Surface Area:24.9
Heavy Atom Count:33
Complexity:534
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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